3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}pyrido[1,2-a]indole-10-carbonitrile

3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}pyrido[1,2-a]indole-10-carbonitrile

CAS: 478247-98-2

Formula: C19H9ClF3N3O

SMILES: FC(F)(F)C1=CC(Cl)=C(OC2=CC=C3C(=C2)N2C=CC=CC2=C3C#N)N=C1

IUPAC: 3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}pyrido[1,2-a]indole-10-carbonitrile

InChI: InChI=1S/C19H9ClF3N3O/c20-15-7-11(19(21,22)23)10-25-18(15)27-12-4-5-13-14(9-24)16-3-1-2-6-26(16)17(13)8-12/h1-8,10H

Composition: C (58.86%), H (2.34%), Cl (9.14%), F (14.70%), N (10.84%), O (4.13%)

Molar Mass: 387.75

Atom Count: 36

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	387.0386241
Formal Charge	0
FSP3	0.05
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	QBCCRWROVVZMOE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	95.37
Topological Polar Surface Area	50.32
Polarizability	36.51
Ring Count	4
Rotatable Bond Count	3

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90%	<2 Days	478247-98-2		$51.35-$524.40$51.35$63.37$86.31$524.40